4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide

C10H14N6O — CID 63107053

IUPAC4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
SMILESCC(C)n1nccc1NC(=O)c1[nH]ncc1N
InChIInChI=1S/C10H14N6O/c1-6(2)16-8(3-4-13-16)14-10(17)9-7(11)5-12-15-9/h3-6H,11H2,1-2H3,(H,12,15)(H,14,17)
InChIKeyQBWJLXDWVFOSOL-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.02
Rot. Bonds3

About 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide

4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide (PubChem CID 63107053) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
PubChem CID63107053
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
SMILESCC(C)n1nccc1NC(=O)c1[nH]ncc1N
InChIInChI=1S/C10H14N6O/c1-6(2)16-8(3-4-13-16)14-10(17)9-7(11)5-12-15-9/h3-6H,11H2,1-2H3,(H,12,15)(H,14,17)
InChIKeyQBWJLXDWVFOSOL-UHFFFAOYSA-N
XLogP1.02
TPSA101.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide (CID 63107053) is 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide is CC(C)n1nccc1NC(=O)c1[nH]ncc1N.
What is the InChIKey of 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is QBWJLXDWVFOSOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-6(2)16-8(3-4-13-16)14-10(17)9-7(11)5-12-15-9/h3-6H,11H2,1-2H3,(H,12,15)(H,14,17).
What are the key properties of 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide?
4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 234.26 g/mol, XLogP of 1.02, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 63107053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).